SCHEMBL5276335

SCHEMBL5276335

CCCCn1nnc(F)c1F

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 5/20 0.44
TOP2A P11388 1/20 0.41
GRM2 Q14416 1/20 0.40
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
HCAR3 P49019 2/20 0.36
HTT P42858 3/20 0.33
LMNA P02545 1/20 0.33
ALDH1A1 P00352 2/20 0.33
GAA P10253 2/20 0.33
HSD17B10 Q99714 1/20 0.32
TSHR P16473 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5276925 0.92 SLC9A1 (0.47) SLC9A1TOP2AGRM2HCAR3LMNA
SCHEMBL5277523 0.87 SLC9A1 (0.41) SLC9A1TOP2AGRM2HCAR3ALDH1A1
SCHEMBL5284734 0.82 SLC9A1 (0.43) SLC9A1TOP2AGRM2MEN1KMT2A
SCHEMBL5284272 0.82 SLC9A1 (0.43) SLC9A1TOP2AGRM2MEN1KMT2A
SCHEMBL5277651 0.82 SLC9A1 (0.43) SLC9A1TOP2AGRM2MEN1KMT2A
SCHEMBL5277681 0.80 GRM2 (0.45) SLC9A1TOP2AGRM2MEN1KMT2A
SCHEMBL5286170 0.80 SLC9A1 (0.42) SLC9A1TOP2AGRM2MEN1KMT2A
SCHEMBL5284094 0.80 SLC9A1 (0.42) SLC9A1TOP2AGRM2MEN1KMT2A
SCHEMBL5276666 0.80 SLC9A1 (0.42) SLC9A1TOP2AGRM2MEN1KMT2A
SCHEMBL5281426 0.80 SLC9A1 (0.42) SLC9A1TOP2AGRM2MEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1859781-A2 Brightening and/or colouring agent with triazoles Henkel Kommanditgesellschaft auf Aktien (DE) 2007-11-28 EP disclosed